N-(2-methyl-6-propan-2-yl-phenyl)-2-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide

Systemtic Name: N-(2-methyl-6-propan-2-yl-phenyl)-2-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide Openeye Name: N-(2-isopropyl-6-methyl-phenyl)-2-[[5-[2-(2-thienyl)ethylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide CAS Name: N-(2-methyl-6-propan-2-ylphenyl)-2-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]thio]propanamide IUPAC Name: N-(2-methyl-6-propan-2-ylphenyl)-2-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide Traditional Name: N-(2-isopropyl-6-methyl-phenyl)-2-[[5-[2-(2-thienyl)ethylamino]-1,3,4-thiadiazol-2-yl]thio]propionamide Formula: C21H26N4OS3 MolecularWeight: 446.65234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=O)C(C)SC2=NN=C(S2)NCCC3=CC=CS3

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=O)C(C)SC2=NN=C(S2)NCCC3=CC=CS3

InChI

InChI=1S/C21H26N4OS3/c1-13(2)17-9-5-7-14(3)18(17)23-19(26)15(4)28-21-25-24-20(29-21)22-11-10-16-8-6-12-27-16/h5-9,12-13,15H,10-11H2,1-4H3,(H,22,24)(H,23,26)